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Methyl 7-oxobicyclo[4.2.0]octa-1,3,5-triene-5-carboxylate
SpectraBase Compound ID 14ExbZpfnYQ
InChI InChI=1S/C10H8O3/c1-13-10(12)7-4-2-3-6-5-8(11)9(6)7/h2-4H,5H2,1H3
InChIKey CNZJGFNTBYUJHF-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C10H8O3
Exact Mass 176.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Exo9dKEUK04
Name Methyl 7-oxobicyclo[4.2.0]octa-1,3,5-triene-5-carboxylate
Alternate Name(s) 7-Oxo-5-bicyclo[4.2.0]octa-1(6),2,4-trienecarboxylic acid methyl ester Methyl 7-oxobicyclo[4.2.0]octa-1(6),2,4-triene-5-carboxylate Methyl 7-oxidanylidenebicyclo[4.2.0]octa-1(6),2,4-triene-5-carboxylate
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Formula C10H8O3
InChI InChI=1S/C10H8O3/c1-13-10(12)7-4-2-3-6-5-8(11)9(6)7/h2-4H,5H2,1H3
InChIKey CNZJGFNTBYUJHF-UHFFFAOYSA-N
Molecular Weight 176.171 g/mol
SMILES C1(c2c(C(=O)OC)cccc2C1)=O
SPLASH splash10-014l-5900000000-a1a56721dc92440849e0
Source of Spectrum H-81-263-1
Wiley ID 1172253